Vitas-M small molecule compound
2-[(5E)-5-(3,4-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-methylbutanoic acid
Catalog ID
STK994793
SMILES COc1cc(ccc1OC)/C=C\1/SC(=S)N(C1=O)C(C(=O)O)C(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H19NO5S2 MW 381.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO5S2/c1-9(2)14(16(20)21)18-15(19)13(25-17(18)24)8-10-5-6-11(22-3)12(7-10)23-4/h5-9,14H,1-4H3,(H,20,21)/b13-8+InChIKey
YDVPRMBLLFDXSB-MDWZMJQESA-NSynonyms
2((5E)5((34DIMETHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)3METHYLBUTANOICACID
2((5E)5(34dimethoxybenzylidene)4oxo2thioxo13thiazolidin3yl)3methylbutanoicacid
CC(C)C(C(=O)O)N1C(=O)C(=CC2=CC(=C(C=C2)OC)OC)SC1=S
COc1cc(ccc1OC)C=C1SC(=S)N(C1=O)C(C(=O)O)C(C)C
InChI=1SC17H19NO5S2c19(2)14(16(20)21)1815(19)13(2517(18)24)8105611(223)12(710)234h5914H14H3(H2021)b138+
MFCD05151172
ZINC000026771411
ZINC000026771412
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